Structure Information
Structure

Compound Identification

SMILES

CCC(O)(C(C)=O)C(=O)OCCOC1CC(C)CCC1C(C)C

InChIKey

InChIKey=PMJLBDZXDWGOCV-UHFFFAOYSA-N

Formula

C18H32O5

Mass

328.449

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Lipids and lipid-like molecules

Class

Prenol lipids

Subclass

Monoterpenoids

Intermediate Tree Nodes

Not available

Direct Parent

Menthane monoterpenoids

Alternative Parents

Molecular Framework

Aliphatic homomonocyclic compounds

Substituents

P-menthane monoterpenoid - Monocyclic monoterpenoid - Beta-keto acid - Fatty acid ester - Acyloin - Fatty acyl - Keto acid - Alpha-hydroxy ketone - Tertiary alcohol - Ketone - Carboxylic acid ester - Ether - Dialkyl ether - Carboxylic acid derivative - Monocarboxylic acid or derivatives - Alcohol - Hydrocarbon derivative - Carbonyl group - Organic oxide - Organic oxygen compound - Organooxygen compound - Aliphatic homomonocyclic compound

Description

This compound belongs to the class of organic compounds known as menthane monoterpenoids. These are monoterpenoids with a structure based on the o-, m-, or p-menthane backbone. P-menthane consists of the cyclohexane ring with a methyl group and a (2-methyl)-propyl group at the 1 and 4 ring position, respectively. The o- and m- menthanes are much rarer, and presumably arise by alkyl migration of p-menthanes.

External Descriptors

Not available

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